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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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135012 51796912 1 ClN2O3C31H31 AB2C3D31E31 -70.05 2.67 -8.89 -0.76 0
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135013 51797041 1 ClN2O5C23H29 AB2C5D23E29 -175.54 7.17 -8.7 -0.28 0
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135014 51797190 1 ClO2F3N3H25C27 AB2C3D3E25F27 -186.28 3.79 -9.82 -1.04 0
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135015 51797929 1 ClN2O2C30H33 AB2C2D30E33 -60.25 5.75 -9.16 -0.52 0
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135016 51798402 1 ClN2O4C22H27 AB2C4D22E27 -159.37 5.41 -8.66 -0.63 0
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135017 51798517 1 ClN2O2C25H33 AB2C2D25E33 -88.49 4.63 -9.35 -0.64 0
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135018 51798565 1 ClSN2O5C25H27 ABC2D5E25F27 -148.0 7.3 -9.58 -0.56 0
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135019 51799025 1 N3O6C30H37 A3B6C30D37 -132.79 7.75 -9.31 -1.33 0
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135020 51799541 1 N2O4C25H38 A2B4C25D38 -173.16 3.07 -9.06 0.13 0
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135021 51799542 1 N2O4C21H30 A2B4C21D30 -147.63 1.1 -8.96 0.22 0
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135022 51799747 2 NO2C13H18 AB2C13D18 -137.88 7.56 -9.37 -0.04 0
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135023 51799748 2 NO2C14H19 AB2C14D19 -133.83 4.4 -8.89 0.02 1
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135024 51799938 1 BrON6H10C14 ABC6D10E14 167.29 5.75 0.0 0.0 0
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135025 51800051 1 N2O4C27H28 A2B4C27D28 -42.61 4.25 -8.64 0.06 0
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135026 51800052 1 N2O4C25H30 A2B4C25D30 -111.81 6.96 -9.13 -0.07 -1
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135027 51800120 1 N3O5C22H22 A3B5C22D22 -112.87 3.83 0.0 0.0 0
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135028 51800174 1 NSO3C12H15 ABC3D12E15 -114.93 3.69 -9.31 -0.49 0
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135029 51800508 1 ClN2O3C27H37 AB2C3D27E37 -146.84 4.77 -9.2 -0.13 0
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135030 51800573 2 NO2C15H22 AB2C15D22 -175.81 4.86 -9.02 -0.14 0
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135031 51800809 1 SN2O6C28H34 AB2C6D28E34 -179.16 8.59 -9.27 -0.25 0
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135032 51801067 1 N2O4C27H40 A2B4C27D40 -177.81 2.14 -8.74 0.12 0
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135033 51801811 1 N2O3C29H36 A2B3C29D36 -97.42 3.51 -9.06 0.23 0
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135034 51801812 1 N2O3C29H36 A2B3C29D36 -98.56 2.86 -8.95 0.11 0
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135035 51801813 1 N2O3C29H36 A2B3C29D36 -96.61 4.2 -9.11 0.11 -1
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135036 51802078 1 BrN3O3H19C27 AB3C3D19E27 50.59 23.12 0.0 0.0 0